ethyl 5-chloranyl-2-[2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-chloranyl-2-[2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-chloro-2-[[2-(5-nitro-2-oxo-1-pyridyl)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-chloro-2-[[2-(5-nitro-2-oxo-1-pyridinyl)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-2-[[2-(5-nitro-2-oxopyridin-1-yl)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-chloro-2-[[2-(2-keto-5-nitro-1-pyridyl)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H16ClN3O6S MolecularWeight: 461.87554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)CN3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)CN3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C20H16ClN3O6S/c1-2-30-20(27)17-16(12-6-4-3-5-7-12)18(21)31-19(17)22-14(25)11-23-10-13(24(28)29)8-9-15(23)26/h3-10H,2,11H2,1H3,(H,22,25)